Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 14/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16151954 | 1.00 | CCR5 (0.41) | CCR5HRH3OPRM1L3MBTL3OPRL1 | |
| SCHEMBL16151962 | 0.92 | L3MBTL3 (0.41) | CCR5HRH3OPRM1L3MBTL3OPRD1 | |
| SCHEMBL16151955 | 0.92 | L3MBTL3 (0.41) | CCR5HRH3OPRM1L3MBTL3OPRD1 | |
| SCHEMBL12188575 | 0.89 | CCR5 (0.47) | CCR5 | |
| SCHEMBL12188488 | 0.89 | CCR5 (0.47) | CCR5 | |
| SCHEMBL16151896 | 0.83 | OPRM1 (0.36) | CCR5OPRM1OPRD1OPRK1 | |
| SCHEMBL16151964 | 0.83 | OPRK1 (0.46) | OPRM1OPRD1OPRK1 | |
| SCHEMBL16151909 | 0.81 | CCR5 (0.43) | CCR5L3MBTL3 | |
| SCHEMBL12188578 | 0.81 | CCR5 (0.43) | CCR5L3MBTL3 | |
| SCHEMBL16151930 | 0.80 | PAX8 (0.42) | HRH3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8853199-B2 | Hydroxylated and methoxylated pyrimidyl cyclopentanes as AKT protein kinase inhibitors | ARRAY BIOPHARMA, INC. (US) | 2014-10-07 | — | — | US | disclosed |